SCHEMBL6534574

SCHEMBL6534574

NC[C@H](O)CNc1cc(-c2ccc(Cl)cc2)nc2ccccc12

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 4/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6534571 1.00 ACP1 (0.54) ACP1
Hydrochloric Acid SCHEMBL6534575 0.99 ACP1 (0.53) ACP1
Hydrochloric Acid SCHEMBL6534576 0.99 ACP1 (0.53) ACP1
SCHEMBL6534480 0.92 SLC2A1 (0.58)
SCHEMBL6534481 0.92 SLC2A1 (0.58)
Hydrochloric Acid SCHEMBL6534375 0.90 SLC2A1 (0.60)
Hydrochloric Acid SCHEMBL6534381 0.90 SLC2A1 (0.60)
Hydrochloric Acid SCHEMBL6534369 0.88 ACP1 (0.54) ACP1
Hydrochloric Acid SCHEMBL6534366 0.88 ACP1 (0.54) ACP1
SCHEMBL6534400 0.88 PDE10A (0.60) ACP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1088818-B1 Quinolin-4-yl derivatives HOFFMANN LA ROCHE (CH) 2004-11-03 EP disclosed
US-6440995-B1 NMDA-RECEPTOR SUBTYPE SELECTIVE BLOCKERS HOFFMAN-LA ROCHE INC. 2002-08-27 US disclosed
EP-1088818-A1 Quinolin-4-yl derivatives F. HOFFMANN-LA ROCHE AG (CH) 2001-04-04 EP disclosed